In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 22nd, 2010 | 17 | No |
Popular Name: 5-(1-propanoyl-4-piperidylidene)-2-thioxo-thiazolidin-4-one 5-(1-propanoyl-4-piperidylidene)…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 1.39 | 2.9 | -44.23 | 0 | 4 | -1 | 56 | 269.371 | 1 | ↓ |
Mid Mid (pH 6-8) | 0.93 | 4.75 | -13.37 | 1 | 4 | 0 | 53 | 270.379 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.